SCHEMBL9569781

SCHEMBL9569781

O=C(Nc1ccc(Cl)c(Cl)c1)NS(=O)(=O)c1ccc2occc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.48
EPHX1 P07099 2/20 0.48
EPHX2 P34913 2/20 0.48
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
MAPT P10636 3/20 0.47
CA2 P00918 5/20 0.45
CA9 Q16790 4/20 0.45
CA4 P22748 1/20 0.45
CA5A P35218 1/20 0.45
LMNA P02545 3/20 0.45
ALDH1A1 P00352 1/20 0.45
CA1 P00915 4/20 0.44
NPC1 O15118 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CHRM1 P11229 1/20 0.44
SLC6A2 P23975 1/20 0.44
PDE4A P27815 1/20 0.44
ADRA1A P35348 1/20 0.44
OPRM1 P35372 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9569778 0.88 CNR1 (0.59) CNR1MEN1KMT2AMAPTCA2
Water SCHEMBL9569771 0.87 CNR1 (0.58) CNR1MEN1KMT2AMAPTCA2
SCHEMBL9569782 0.84 CA12 (0.47) CNR1MEN1KMT2AMAPTCA2
SCHEMBL9569777 0.83 CA12 (0.57) MEN1KMT2ACA2CA9CA4
SCHEMBL9422413 0.79 CA12 (0.50) CNR1MEN1KMT2AMAPTCA2
SCHEMBL9486556 0.79 MEN1 (0.67) EPHX1EPHX2MEN1KMT2AMAPT
SCHEMBL9569775 0.78 CA9 (0.40) CNR1MEN1KMT2AMAPTCA2
SCHEMBL9487998 0.76 KMT2A (0.76) EPHX1EPHX2MEN1KMT2AMAPT
SCHEMBL9097173 0.76 MEN1 (0.57) EPHX1EPHX2MEN1KMT2AMAPT
SCHEMBL9529462 0.76 EPHX1 (0.60) EPHX1EPHX2MEN1KMT2AMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0560554-A2 Antitumor compositions and methods of treatment ELI LILLY AND COMPANY (US) 1993-09-15 EP claimed
US-5169860-A Benzofuran or benzothiophene arylsulfonylureas ELI LILLY AND COMPANY (US) 1992-12-08 US claimed
EP-0560554-A2 Antitumor compositions and methods of treatment ELI LILLY AND COMPANY (US) 1993-09-15 EP disclosed
US-5169860-A Benzofuran or benzothiophene arylsulfonylureas ELI LILLY AND COMPANY (US) 1992-12-08 US disclosed